N-[[1,3-bis(oxidanylidene)-2-phenyl-isoindol-4-yl]carbamothioyl]-3-methyl-butanamide

Systemtic Name: N-[[1,3-bis(oxidanylidene)-2-phenyl-isoindol-4-yl]carbamothioyl]-3-methyl-butanamide Openeye Name: N-[(1,3-dioxo-2-phenyl-isoindolin-4-yl)carbamothioyl]-3-methyl-butanamide CAS Name: N-[[(1,3-dioxo-2-phenyl-4-isoindolyl)amino]-sulfanylidenemethyl]-3-methylbutanamide IUPAC Name: N-[(1,3-dioxo-2-phenylisoindol-4-yl)carbamothioyl]-3-methylbutanamide Traditional Name: N-[(1,3-diketo-2-phenyl-isoindolin-4-yl)thiocarbamoyl]-3-methyl-butyramide Formula: C20H19N3O3S MolecularWeight: 381.44816

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC(=S)NC1=CC=CC2=C1C(=O)N(C2=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)CC(=O)NC(=S)NC1=CC=CC2=C1C(=O)N(C2=O)C3=CC=CC=C3

InChI

InChI=1S/C20H19N3O3S/c1-12(2)11-16(24)22-20(27)21-15-10-6-9-14-17(15)19(26)23(18(14)25)13-7-4-3-5-8-13/h3-10,12H,11H2,1-2H3,(H2,21,22,24,27)